Glycoside
GD114269
Name:
14-{[4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy}-6,15-dihydroxy-12-[(5-hydroxy-4-methoxy-6-methyloxan-2-yl)oxy]-5,7,13,15-tetramethyl-1,9-dioxaspiro[2.13]hexadecane-4,10-dioneFormula:
C33H57O13NSmiles:
COC1CC(OC2CC(=O)OCC(C)C(O)C(C)C(=O)C3(CO3)CC(C)(O)C(OC3OC(C)CC(N(C)C)C3O)C2C)OC(C)C1OAglycone:
CC1CC(N(C)C)C(O)C(OC2C(C)C(O)CC(=O)OCC(C)C(O)C(C)C(=O)C3(CO3)CC2(C)O)O1Sugarmoiety:
COC1CC(O)OC(C)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.94 |
| AlogP: | 0.39 | Num_rotatable_bonds: | 6 |
| MolWt: | 675.81 | Num_heavy_atoms: | 47 |
| TPSA: | 186.21 | NumAromaticRings: | 0 |
Unique Aglycone
AD44946
Formula: C26H45O10N
Smiles:
CC1CC(N(C)C)C(O)C(OC2C(C)C(O)CC(=O)OCC(C)C(O)C(C)C(=O)C3(CO3)CC2(C)O)O1| HBA: | 11 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.92 |
| AlogP: | -0.15 | Num_rotatable_bonds: | 3 |
| MolWt: | 531.64 | Num_heavy_atoms: | 37 |
| TPSA: | 158.52 | NumAromaticRings: | 0 |
